Summary

IMPPAT Phytochemical identifier: IMPHY017083

Phytochemical name: N-octan-3-ylidenehydroxylamine

Synonymous chemical names:
3-octanone oxime

External chemical identifiers:
CID:138959

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Chemical structure information

SMILES:
CCCCCC(=NO)CC

InChI:
InChI=1S/C8H17NO/c1-3-5-6-7-8(4-2)9-10/h10H,3-7H2,1-2H3

InChIKey:
ODXYAIIKLLODAU-UHFFFAOYSA-N

DeepSMILES:
CCCCCC=NO))CC

Functional groups:
CC(C)=NO

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organic nitrogen compounds

ClassyFire Class: Organonitrogen compounds

ClassyFire Subclass: Oximes

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Fatty alcohols

NP-Likeness score: 0.264

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Chemical structure download